6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione

C11H8ClNO4 — CID 13014150

IUPAC6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione
SMILESO=C1NC(=O)C2(CCOc3ccc(Cl)cc32)O1
InChIInChI=1S/C11H8ClNO4/c12-6-1-2-8-7(5-6)11(3-4-16-8)9(14)13-10(15)17-11/h1-2,5H,3-4H2,(H,13,14,15)
InChIKeyMKEKVTYZTKVMKC-UHFFFAOYSA-N
MW253.64 g/mol
LogP1.58
Rot. Bonds

About 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione

6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione (PubChem CID 13014150) has the molecular formula C11H8ClNO4 and a molecular weight of 253.64 g/mol. Its IUPAC name is 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione.

Molecular Properties

Compound Name6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione
PubChem CID13014150
Molecular FormulaC11H8ClNO4
Molecular Weight253.64 g/mol
Exact Mass253.01
IUPAC Name6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione
SMILESO=C1NC(=O)C2(CCOc3ccc(Cl)cc32)O1
InChIInChI=1S/C11H8ClNO4/c12-6-1-2-8-7(5-6)11(3-4-16-8)9(14)13-10(15)17-11/h1-2,5H,3-4H2,(H,13,14,15)
InChIKeyMKEKVTYZTKVMKC-UHFFFAOYSA-N
XLogP1.58
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.64
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione with MolForge

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Related Compounds

4,6-dichloro-2,3-dihydrochromene-4-carboxamide
CID 13053015
6-chloro-4-phenyl-2,3-dihydrochromene-4-carboxylic acid
CID 135311490
6-chlorospiro[4H-1,4-benzoxazine-2,1'-cyclopropane]-3-one
CID 115097029
6-chloro-4-(1H-imidazol-2-yl)-2,3-dihydrochromen-4-ol
CID 58951608
2-[[(2S,4R)-2-bicyclo[2.2.1]heptanyl]imino]-6'-chlorospiro[1,3-thiazolidine-5,4'-2,3-dihydrochromene]-4-one
CID 136503094
(1'R,4S)-6-chloro-N-methylspiro[2,3-dihydrochromene-4,2'-cyclopropane]-1'-carboxamide
CID 128969666
4-propyliminospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2-one
CID 137317036
7-chlorospiro[2,5-dihydro-1,5-benzoxazepine-3,1'-cyclopropane]-4-one
CID 115099122
5-chlorospiro[1H-indole-3,4'-oxane]-2-one
CID 106701967
6-chloro-3'-isoquinolin-4-ylspiro[2,3-dihydrochromene-4,5'-imidazolidine]-2',4'-dione
CID 156906822
5-(2,4-dichlorophenyl)-5-ethyl-1,3-oxazolidine-2,4-dione
CID 82098501
7-chlorospiro[4H-1,4-benzoxazine-2,1'-cyclopropane]-3-one
CID 115097111

Frequently Asked Questions

What is the IUPAC name of 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione?
The IUPAC name of 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione (CID 13014150) is 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione.
What is the SMILES notation for 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione?
The canonical SMILES for 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione is O=C1NC(=O)C2(CCOc3ccc(Cl)cc32)O1.
What is the InChIKey of 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione?
The InChIKey is MKEKVTYZTKVMKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClNO4/c12-6-1-2-8-7(5-6)11(3-4-16-8)9(14)13-10(15)17-11/h1-2,5H,3-4H2,(H,13,14,15).
What are the key properties of 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione?
6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione has a molecular weight of 253.64 g/mol, XLogP of 1.58, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6'-chlorospiro[1,3-oxazolidine-5,4'-2,3-dihydrochromene]-2,4-dione is sourced from PubChem (CID 13014150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).